COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438110
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-({1-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]piperidin-4-yl}methyl)prop-2-enamide
Smiles: O=C(/C=C/c1ccc2c(c1)OCO2)NCC1CCN(CC1)C(=O)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 462.5
Empirical Formula: C26H26N2O6

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 3.977
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 86
Number of rings: 5

     

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